[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol

C15H17NO2 — CID 80628087

IUPAC[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol
SMILESCc1ccc(Oc2ncc(CO)cc2C)cc1C
InChIInChI=1S/C15H17NO2/c1-10-4-5-14(7-11(10)2)18-15-12(3)6-13(9-17)8-16-15/h4-8,17H,9H2,1-3H3
InChIKeyPUHIDJFSRVJOQW-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.29
Rot. Bonds3

About [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol

[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol (PubChem CID 80628087) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol
PubChem CID80628087
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol
SMILESCc1ccc(Oc2ncc(CO)cc2C)cc1C
InChIInChI=1S/C15H17NO2/c1-10-4-5-14(7-11(10)2)18-15-12(3)6-13(9-17)8-16-15/h4-8,17H,9H2,1-3H3
InChIKeyPUHIDJFSRVJOQW-UHFFFAOYSA-N
XLogP3.29
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methyl-6-naphthalen-2-yloxy-3-pyridinyl)methanol
CID 80629021
1-[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]-N-methylmethanamine
CID 80635573
[2-(3,4-dimethylphenoxy)pyrimidin-5-yl]methanol
CID 113387908
[6-(4-bromo-3-fluorophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80628936
[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol
CID 80628637
[6-[3-(dimethylamino)phenoxy]-5-methyl-3-pyridinyl]methanol
CID 80628307
[6-(4-methoxy-3-nitrophenoxy)-5-methyl-3-pyridinyl]methanol
CID 103201814
[5-chloro-6-(3-fluoro-4-methylphenoxy)-3-pyridinyl]methanol
CID 107170106
[5-methyl-6-(3-nitrophenoxy)-3-pyridinyl]methanol
CID 80629220
[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol
CID 80628218
[6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol
CID 80628736
[6-(2,3-dichlorophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80629406

Frequently Asked Questions

What is the IUPAC name of [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol?
The IUPAC name of [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol (CID 80628087) is [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol.
What is the SMILES notation for [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol?
The canonical SMILES for [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol is Cc1ccc(Oc2ncc(CO)cc2C)cc1C.
What is the InChIKey of [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol?
The InChIKey is PUHIDJFSRVJOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-10-4-5-14(7-11(10)2)18-15-12(3)6-13(9-17)8-16-15/h4-8,17H,9H2,1-3H3.
What are the key properties of [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol?
[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol has a molecular weight of 243.31 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol is sourced from PubChem (CID 80628087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).